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Mathematical Models and Computer Simulations

Simulation and Analytical Modeling of Quantum Gas Dynamics Taking Into Account the Temperature and Electric Fields and Frictional Forces

Sergey Aleksandrovich Nekrasov, Dmitry N. Chernoivan

Published Jul 1, 2019• 0 citations
Publisher

Abstract

Abstract The article investigates the questions of calculating the dynamics of quantum gases on the basis of the stochastic interpretation of Schrödinger equation. A comparison of several appropriate methods for solve of equations of quantum mechanics – based on the method of simulating the dynamics of quantum particles as a Brownian motion, using an analytical solution of the equations of quantum hydrodynamics and directly the Schrödinger equation. An example of modeling the gas flow of quantum particles with allowance for the temperature and electric fields and friction forces is considered. The influence of the form factor of the initial distribution of the gas density, temperature, and parameters of the computational method is studied.

DOI
10.1134/s2070048219040112

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Abstract The article investigates the questions of calculating the dynamics of quantum gases on the basis of the stochastic interpretation of Schrödinger equation. A comparison of several appropriate methods for solve of equations of quantum mechanics – based on the method of simulating the dynamics of quantum particles as a Brownian motion, using an analytical solution of the equations of quantum hydrodynamics and directly the Schrödinger equation. An example of modeling the gas flow of quantum particles with allowance for the temperature and electric fields and friction forces is considered. The influence of the form factor of the initial distribution of the gas density, temperature, and parameters of the computational method is studied.
Nonlinear friction forces are a problem in classical Brownian motion for a long time [1]. They are described either by Langevin or by Fokker-Planck equations [2-4]. However, the rigorous generalized Langevin equation is linear, which points out that nonlinear friction forces possess a macroscopic hydrodynamic origin [1]. For this reason, they are not present in the modern quantum theory of open systems [5]. The scope of the present paper is to investigate the nonlinear friction effect on quantum mechanics. The analysis is based on a dissipative Madelung quantum hydrodynamics. Thus, the nonlinear friction is a result of nonlinear non-equilibrium thermodynamics in contrast to the traditional mechanical nonlinear friction forces. A quantum particle in vacuum is described by the Schrodinger equation
We describe recent development of quantum hydrodynamics for ultracold Bose particle studying and consider different kinds of interactions. The method of derivation of equations describing the evolution of the neutral Bose particle system at low temperatures is described. Despite the fact that we consider the neutral particles we account the short-range interaction between particles. We consider the particles in the Bose-Einstein condensate (BEC) state. This method is called the method of quantum hydrodynamics, because natural for of the quantum mechanics rewritten in terms of material fields of observable quantities in three dimensional space is the set of equations, which look like the hydrodynamics equations. It can be shown that from the quantum hydrodynamics equations can be derived macroscopic non-linear Schrodinger equation. Most famous non-linear Schrodinger equation is the Gross-Pitaevskii (GP) equation, which contains nonlinearity of the third degree. There are generalizations of the GP equation. New term appears in the GP equation at account of the three-particle interaction. This term contains nonlinearity of the fifth degree. At more detailed account of the two particle interaction we come to the nonlocal non-linear Schrodinger equation. This equation contains spatial derivatives of the order parameter in the non-linear terms caused by the interaction. In this terminology the GP equation corresponds to the first order by the interaction radius. For the BEC of the neutral particles with anisotropic long-range dipole-dipole interaction the generalization of the GP equation was also suggested. Detailed analyses of the applicability conditions shows that this equation valid for the system of dipoles parallel to each other, which do not change their direction, and where the dipole-dipole interaction interferences translational motion of particles.
In the frames of classical mechanics the generalized Langevin equation is derived for an arbitrary mechanical subsystem coupled to the harmonic bath of a solid. A time-acting temperature operator is introduced for the quantum Klein-Kramers and Smoluchowski equations, accounting for the effect of the quantum thermal bath oscillators. The model of Brownian emitters is theoretically studied and the relevant evolutionary equations for the probability density are derived. The Schrodinger equation is explained via collisions of the target point particles with the quantum force carriers, transmitting the fundamental interactions between the point particles. Thus, electrons and other point particles are no waves and the wavy chapter of quantum mechanics originated for the force carriers. A stochastic Lorentz-Langevin equation is proposed to describe the underlaying Brownian-like motion of the point particles in quantum mechanics. Considering the Brownian dynamics in the frames of the Bohmian mechanics, the density functional Bohm-Langevin equation is proposed, and the relevant Smoluchowski-Bohm equation is derived. A nonlinear master equation is proposed by proper quantization of the classical Klein-Kramers equation. Its equilibrium solution in the exact canonical Gibbs density operator, while the well-known Caldeira-Leggett equation is simply a linearization at high temperature. In the case of a free quantum Brownian particles, a new law for the spreading of the wave packet it discovered, which represents the quantum generalization of the classical Einstein law of Brownian motion. A new projector operator is proposed for the collapse of the wave function of a quantum particle moving in a classical environment. Its application results in dissipative Schrodinger equations, as well as in a new form of dissipative Liouville equation in classical mechanics.
We derive the classical equations of hydrodynamic type (Euler equation and the continuity equation) from which the Schrodinger equation follows as a limit case. It is shown that the statistical ensemble corresponding to quantum system and described by the Schrodinger equation, can be considered as an inviscid gas obeying the ideal gas law with quickly oscillating sign-alternating temperature. This statistical ensemble performs the complex movements consisting of smooth average movement and fast oscillations. It is shown that average movements of statistical ensemble are described by Schrodinger equation. A model of quantum motion within the limits of classical mechanics which corresponds to the considered hydrodynamic system is suggested.
Stochastic methods are ubiquitous to a variety of fields, ranging from physics to economics and mathematics. In many cases, in the investigation of natural processes, stochasticity arises every time one considers the dynamics of a system in contact with a somewhat bigger system, an environment with which it is considered in thermal equilibrium. Any small fluctuation of the environment has some random effect on the system. In physics, stochastic methods have been applied to the investigation of phase transitions, thermal and electrical noise, thermal relaxation, quantum information, Brownian motion and so on. In this review, we will focus on the so-called stochastic Schrödinger equation. This is useful as a starting point to investigate the dynamics of open quantum systems capable of exchanging energy and momentum with an external environment. We discuss in some detail the general derivation of a stochastic Schrödinger equation and some of its recent applications to spin thermal transport, thermal relaxation, and Bose-Einstein condensation. We thoroughly discuss the advantages of this formalism with respect to the more common approach in terms of the reduced density matrix. The applications discussed here constitute only a few examples of a much wider range of applicability.
A Brownian particle in an ideal quantum gas is considered. The mean square displacement (MSD) is derived. The Bose-Einstein or Fermi-Dirac distribution, other than the Maxwell-Boltzmann distribution, provides a different stochastic force compared with the classical Brownian motion. The MSD, which depends on the thermal wavelength and the density of medium particles, reflects the quantum effect on the Brownian particle explicitly. The result shows that the MSD in an ideal Bose gas is shorter than that in a Fermi gas. The behavior of the quantum Brownian particle recovers the classical Brownian particle as the temperature raises. At low temperatures, the quantum effect becomes obvious. For example, there is a random motion of the Brownian particle due to the fermionic exchange interaction even the temperature is near the absolute zero.